1-chloranylpropan-2-one; 4-nitrobenzoic acid

Systemtic Name: 1-chloranylpropan-2-one; 4-nitrobenzoic acid Openeye Name: 1-chloropropan-2-one; 4-nitrobenzoic acid CAS Name: 1-chloro-2-propanone; 4-nitrobenzoic acid IUPAC Name: 1-chloropropan-2-one; 4-nitrobenzoic acid Traditional Name: 1-chloroacetone; 4-nitrobenzoic acid Formula: C10H10ClNO5 MolecularWeight: 259.6431

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCl.C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CCl.C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H5NO4.C3H5ClO/c9-7(10)5-1-3-6(4-2-5)8(11)12;1-3(5)2-4/h1-4H,(H,9,10);2H2,1H3